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Diperodon
SpectraBase Compound ID 6YkzEbL4xqG
InChI InChI=1S/C22H27N3O4/c26-21(23-18-10-4-1-5-11-18)28-17-20(16-25-14-8-3-9-15-25)29-22(27)24-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,26)(H,24,27)
InChIKey YUGZHQHSNYIFLG-UHFFFAOYSA-N
Mol Weight 397.48 g/mol
Molecular Formula C22H27N3O4
Exact Mass 397.200156 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID DkQL24I8wEW
Name Diperodon
Source of Sample Sigma-Aldrich Company Llc
Catalog Number Free base of D8536
Lot Number Free base of 062H0404V
Accessory DurasamplIR II
CAS Registry Number 101-08-6
Classification vasodilator
Copyright Copyright © 2014-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27N3O4
InChI InChI=1S/C22H27N3O4/c26-21(23-18-10-4-1-5-11-18)28-17-20(16-25-14-8-3-9-15-25)29-22(27)24-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,26)(H,24,27)
InChIKey YUGZHQHSNYIFLG-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N(c1ccccc1)C(OC(COC(Nc1ccccc1)=O)CN1CCCCC1)=O
Sample Preparation Procedure The HCl salt was dissolved in 0.5 ml water in a test tube, and 1 drop of 30% NaOH solution was added, causing the clear solution to turn cloudy white. 1 ml dichloromethane was added to the test tube, which was shaken thoroughly using a vortex mixer. The test tube was spun in a centrifuge to separate the organic and aqueous layers. The bottom organic layer was retrieved with a pipette and placed in another clean test tube. Most of the solvent was evaporated from the tube using a flow of nitrogen gas, and the remaining solution was used to create a film on the diamond window for ATR-IR.
Source of Spectrum Forensic Spectral Research
Synonyms 3-​(1-​Piperidinyl)​-​1,2-​propanediol bis(phenylcarbamate); [2-(Phenylcarbamoyloxy)-3-piperidin-1-ylpropyl] N-phenylcarbamate
Technique ATR-Film (MeCl2) (DuraSamplIR II)